data_LACS ################################# # LACS Output Information # ################################# ############################################################ # LACS Designator Definition # # # # Index Value Definition # # # # 0 Outliers # # 1 Normal points # # # ############################################################ save_LACS_CACB_CA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17226_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -4.86 _LACS_plot.Line_1_terminator_val_y_1 -1.86 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.01 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.11 _LACS_plot.Line_2_terminator_val_x_2 8.74 _LACS_plot.Line_2_terminator_val_y_2 6.76 _LACS_plot.Y_axis_chem_shift_offset -0.26 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 77 MET -1.44 3.60 0 10 ARG -0.02 0.06 1 11 GLU -0.17 0.23 1 13 ILE -0.86 -0.07 1 14 SER -2.85 -1.09 1 15 ILE 6.72 5.21 1 16 TYR 3.79 4.07 1 17 ASP 2.95 2.93 1 18 LYS 3.98 3.83 1 19 ILE 1.00 0.77 1 22 HIS 5.58 7.05 1 23 GLU 3.79 3.31 1 24 ALA 1.37 1.95 1 25 ILE 5.72 4.28 1 26 GLU 4.36 4.42 1 27 VAL 4.76 4.19 1 28 VAL 5.41 4.47 1 29 VAL 6.98 5.84 1 30 GLU 3.96 3.74 1 31 ASP 1.90 3.68 1 32 PHE 2.95 3.28 1 33 TYR 7.19 7.33 1 34 VAL 6.93 5.35 1 35 ARG 4.63 2.96 1 36 VAL 4.20 4.56 1 37 LEU 3.69 1.99 1 38 ALA -0.38 -0.46 1 39 ASP -1.66 -0.76 1 40 ASP 3.21 2.52 1 41 GLN 0.71 1.86 1 42 LEU -4.09 -0.68 1 43 SER 4.64 4.65 1 44 ALA 3.41 2.27 1 45 PHE 5.58 3.55 1 46 PHE -0.50 0.15 1 47 SER 3.56 2.73 1 49 THR 1.26 1.98 1 50 ASN 1.10 -0.88 1 51 MET 4.17 0.38 1 53 ARG 3.45 2.27 1 54 LEU 3.73 3.40 1 55 LYS 6.37 5.60 1 57 LYS 2.04 0.70 1 58 GLN -0.87 1.63 1 59 VAL 6.45 5.14 1 60 GLU 1.74 2.74 1 61 PHE 6.39 4.99 1 62 PHE 4.33 3.78 1 63 ALA 4.62 3.94 1 64 ALA 2.67 2.28 1 65 ALA 3.97 1.75 1 66 LEU 1.51 -1.06 1 70 GLU -1.56 -0.81 1 72 TYR -0.61 -0.68 1 73 THR -0.24 -0.72 1 75 ALA -0.22 -0.33 1 78 LYS 3.85 4.27 1 79 GLN 3.63 4.05 1 80 VAL 3.36 2.90 1 81 HIS 3.03 2.55 1 82 GLN -0.19 0.84 1 84 ARG 2.14 1.06 1 86 ILE -4.86 -1.78 1 87 THR 3.77 1.26 1 88 MET 2.92 4.46 1 89 HIS 3.61 5.59 1 90 HIS 4.40 3.71 1 91 PHE 4.60 3.05 1 92 SER 2.18 1.84 1 93 LEU 8.03 5.52 1 94 VAL 4.90 2.38 1 95 ALA 2.65 4.83 1 97 HIS 4.66 3.01 1 98 LEU 4.95 3.57 1 99 ALA 4.12 3.31 1 100 ASP 3.09 2.69 1 101 ALA 3.67 3.33 1 102 LEU 6.54 5.29 1 103 THR 3.53 2.41 1 104 ALA -0.23 -0.40 1 105 ALA 4.65 3.26 1 110 GLU 5.34 3.41 1 111 THR 8.48 6.57 1 112 ILE 6.37 5.29 1 113 THR 3.34 3.28 1 114 GLU 6.41 5.23 1 115 ILE 4.94 2.47 1 116 LEU 4.23 2.89 1 118 VAL 0.49 -0.12 1 119 ILE 8.74 6.51 1 120 ALA 1.88 0.70 1 122 LEU 5.72 3.63 1 123 ALA 4.14 2.95 1 124 VAL 1.23 3.11 1 125 ASP 4.54 5.16 1 126 VAL -1.76 -0.70 1 127 THR 0.61 1.39 1 128 SER -0.63 0.14 1 130 GLU -0.10 0.09 1 131 SER 0.09 0.07 1 132 THR -0.20 -0.10 1 133 THR -0.12 0.08 1 134 ALA 0.88 1.28 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17226_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -4.86 _LACS_plot.Line_1_terminator_val_y_1 3.00 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.99 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.89 _LACS_plot.Line_2_terminator_val_x_2 8.74 _LACS_plot.Line_2_terminator_val_y_2 -1.98 _LACS_plot.Y_axis_chem_shift_offset -0.26 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 77 MET -1.44 5.04 0 10 ARG -0.02 0.08 1 11 GLU -0.17 0.40 1 13 ILE -0.86 0.79 1 14 SER -2.85 1.76 1 15 ILE 6.72 -1.51 1 16 TYR 3.79 0.28 1 17 ASP 2.95 -0.02 1 18 LYS 3.98 -0.15 1 19 ILE 1.00 -0.23 1 22 HIS 5.58 1.47 1 23 GLU 3.79 -0.48 1 24 ALA 1.37 0.58 1 25 ILE 5.72 -1.44 1 26 GLU 4.36 0.06 1 27 VAL 4.76 -0.57 1 28 VAL 5.41 -0.94 1 29 VAL 6.98 -1.14 1 30 GLU 3.96 -0.22 1 31 ASP 1.90 1.78 1 32 PHE 2.95 0.33 1 33 TYR 7.19 0.14 1 34 VAL 6.93 -1.58 1 35 ARG 4.63 -1.67 1 36 VAL 4.20 0.36 1 37 LEU 3.69 -1.70 1 38 ALA -0.38 -0.08 1 39 ASP -1.66 0.90 1 40 ASP 3.21 -0.69 1 41 GLN 0.71 1.15 1 42 LEU -4.09 3.41 1 43 SER 4.64 0.01 1 44 ALA 3.41 -1.14 1 45 PHE 5.58 -2.03 1 46 PHE -0.50 0.65 1 47 SER 3.56 -0.83 1 49 THR 1.26 0.72 1 50 ASN 1.10 -1.98 1 51 MET 4.17 -3.79 1 53 ARG 3.45 -1.18 1 54 LEU 3.73 -0.33 1 55 LYS 6.37 -0.77 1 57 LYS 2.04 -1.34 1 58 GLN -0.87 2.50 1 59 VAL 6.45 -1.31 1 60 GLU 1.74 1.00 1 61 PHE 6.39 -1.40 1 62 PHE 4.33 -0.55 1 63 ALA 4.62 -0.68 1 64 ALA 2.67 -0.39 1 65 ALA 3.97 -2.22 1 66 LEU 1.51 -2.57 1 70 GLU -1.56 0.75 1 72 TYR -0.61 -0.07 1 73 THR -0.24 -0.48 1 75 ALA -0.22 -0.11 1 78 LYS 3.85 0.42 1 79 GLN 3.63 0.42 1 80 VAL 3.36 -0.46 1 81 HIS 3.03 -0.48 1 82 GLN -0.19 1.03 1 84 ARG 2.14 -1.08 1 86 ILE -4.86 3.08 1 87 THR 3.77 -2.51 1 88 MET 2.92 1.54 1 89 HIS 3.61 1.98 1 90 HIS 4.40 -0.69 1 91 PHE 4.60 -1.55 1 92 SER 2.18 -0.34 1 93 LEU 8.03 -2.51 1 94 VAL 4.90 -2.52 1 95 ALA 2.65 2.18 1 97 HIS 4.66 -1.65 1 98 LEU 4.95 -1.38 1 99 ALA 4.12 -0.81 1 100 ASP 3.09 -0.40 1 101 ALA 3.67 -0.34 1 102 LEU 6.54 -1.25 1 103 THR 3.53 -1.12 1 104 ALA -0.23 -0.17 1 105 ALA 4.65 -1.39 1 110 GLU 5.34 -1.93 1 111 THR 8.48 -1.91 1 112 ILE 6.37 -1.08 1 113 THR 3.34 -0.06 1 114 GLU 6.41 -1.18 1 115 ILE 4.94 -2.47 1 116 LEU 4.23 -1.34 1 118 VAL 0.49 -0.61 1 119 ILE 8.74 -2.23 1 120 ALA 1.88 -1.18 1 122 LEU 5.72 -2.09 1 123 ALA 4.14 -1.19 1 124 VAL 1.23 1.88 1 125 ASP 4.54 0.62 1 126 VAL -1.76 1.06 1 127 THR 0.61 0.78 1 128 SER -0.63 0.77 1 130 GLU -0.10 0.19 1 131 SER 0.09 -0.02 1 132 THR -0.20 0.10 1 133 THR -0.12 0.20 1 134 ALA 0.88 0.40 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17226_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -4.86 _LACS_plot.Line_1_terminator_val_y_1 0.53 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.16 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.22 _LACS_plot.Line_2_terminator_val_x_2 8.48 _LACS_plot.Line_2_terminator_val_y_2 -0.75 _LACS_plot.Y_axis_chem_shift_offset -0.04 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 126 VAL 4.54 2.62 0 10 ARG -0.02 -0.02 1 11 GLU -0.17 -0.05 1 13 ILE -0.86 0.19 1 14 SER -2.85 0.10 1 15 ILE 6.72 -0.61 1 16 TYR 3.79 -0.88 1 17 ASP 2.95 -0.35 1 18 LYS 3.98 -0.34 1 19 ILE 1.00 0.22 1 22 HIS 5.58 -0.95 1 23 GLU 3.79 -0.22 1 24 ALA 1.37 -0.04 1 25 ILE 5.72 -0.73 1 26 GLU 4.36 -0.31 1 27 VAL 4.76 -0.17 1 28 VAL 5.41 -0.26 1 29 VAL 6.98 0.03 1 30 GLU 3.96 0.23 1 31 ASP 1.90 0.11 1 32 PHE 2.95 -0.52 1 33 TYR 7.19 0.32 1 34 VAL 6.93 -0.24 1 35 ARG 4.63 -0.50 1 36 VAL 4.20 -0.96 1 37 LEU 3.69 -0.25 1 38 ALA -0.38 0.11 1 39 ASP -1.66 0.09 1 40 ASP 3.21 -0.15 1 41 GLN 0.71 -0.02 1 42 LEU -4.09 0.39 1 43 SER 4.64 -0.41 1 44 ALA 3.41 -0.22 1 45 PHE 5.58 -1.06 1 46 PHE -0.50 -0.05 1 47 SER 3.56 -0.23 1 50 ASN 1.10 -0.07 1 51 MET 4.17 0.24 1 53 ARG 3.45 -0.41 1 54 LEU 3.73 -0.85 1 55 LYS 6.37 0.35 1 57 LYS 2.04 -0.31 1 58 GLN -0.87 0.31 1 59 VAL 6.45 -0.37 1 60 GLU 1.74 -0.35 1 61 PHE 6.39 -1.48 1 62 PHE 4.33 -0.79 1 63 ALA 4.62 -0.38 1 64 ALA 2.67 -0.48 1 65 ALA 3.97 -0.57 1 66 LEU 1.51 0.02 1 72 TYR -0.61 0.03 1 75 ALA -0.22 -0.29 1 77 MET -1.44 1.97 1 78 LYS 3.85 1.82 1 79 GLN 3.63 0.41 1 80 VAL 3.36 0.27 1 82 GLN 3.03 1.07 1 84 ARG -0.19 0.20 1 86 ILE 2.14 -0.58 1 87 THR -4.86 0.31 1 89 HIS 2.92 -0.61 1 90 HIS 3.61 -1.35 1 91 PHE 4.40 -2.55 1 93 LEU 2.18 -0.66 1 94 VAL 8.03 -0.99 1 95 ALA 4.90 -1.08 1 98 LEU 4.66 -0.28 1 99 ALA 4.95 -0.44 1 100 ASP 4.12 -0.26 1 101 ALA 3.09 0.13 1 102 LEU 3.67 -0.39 1 103 THR 6.54 -0.41 1 104 ALA 3.53 -0.13 1 105 ALA -0.23 0.13 1 110 GLU 4.65 -0.20 1 111 THR 5.34 -0.16 1 112 ILE 8.48 -0.81 1 113 THR 6.37 -0.62 1 114 GLU 3.34 -0.33 1 115 ILE 6.41 -0.77 1 116 LEU 4.94 -0.47 1 118 VAL 4.23 -0.31 1 119 ILE 0.49 -0.07 1 122 LEU 1.88 0.09 1 123 ALA 5.72 -1.62 1 124 VAL 4.14 -0.32 1 125 ASP 1.23 0.62 1 127 THR -1.76 0.52 1 128 SER 0.61 0.39 1 130 GLU -0.63 0.15 1 131 SER -0.10 0.19 1 132 THR 0.09 0.16 1 133 THR -0.20 0.04 1 134 ALA -0.12 0.03 1 136 VAL 0.88 -0.09 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17226_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -4.86 _LACS_plot.Line_1_terminator_val_y_1 -0.18 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.26 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.56 _LACS_plot.Line_2_terminator_val_x_2 8.48 _LACS_plot.Line_2_terminator_val_y_2 2.39 _LACS_plot.Y_axis_chem_shift_offset -0.87 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 77 MET -1.44 6.50 0 10 ARG -0.02 -0.40 1 13 ILE -0.86 -0.48 1 14 SER -2.85 0.42 1 15 ILE 6.72 0.61 1 16 TYR 3.79 -0.25 1 17 ASP 2.95 3.56 1 18 LYS 3.98 2.64 1 19 ILE 1.00 -1.73 1 22 HIS 5.58 2.87 1 23 GLU 3.79 2.18 1 24 ALA 1.37 2.03 1 25 ILE 5.72 0.99 1 26 GLU 4.36 2.31 1 27 VAL 4.76 2.94 1 28 VAL 5.41 1.43 1 29 VAL 6.98 1.25 1 30 GLU 3.96 2.42 1 31 ASP 1.90 1.72 1 32 PHE 2.95 1.25 1 33 TYR 7.19 3.15 1 34 VAL 6.93 3.06 1 35 ARG 4.63 2.59 1 36 VAL 4.20 1.35 1 37 LEU 3.69 0.93 1 38 ALA -0.38 -1.54 1 39 ASP -1.66 1.00 1 40 ASP 3.21 2.21 1 41 GLN 0.71 0.66 1 42 LEU -4.09 1.14 1 43 SER 4.64 3.19 1 44 ALA 3.41 2.54 1 45 PHE 5.58 0.51 1 46 PHE -0.50 1.07 1 47 SER 3.56 0.76 1 49 THR 1.26 -0.98 1 50 ASN 1.10 -0.12 1 51 MET 4.17 2.57 1 54 LEU 3.73 0.44 1 55 LYS 6.37 2.35 1 57 LYS 2.04 0.99 1 58 GLN -0.87 3.11 1 59 VAL 6.45 1.23 1 60 GLU 1.74 3.06 1 61 PHE 6.39 2.27 1 62 PHE 4.33 1.98 1 63 ALA 4.62 1.27 1 64 ALA 2.67 3.76 1 65 ALA 3.97 1.23 1 66 LEU 1.51 -1.93 1 72 TYR -0.61 0.80 1 78 LYS 3.85 2.33 1 79 GLN 3.63 3.54 1 80 VAL 3.36 1.58 1 81 HIS 3.03 1.53 1 82 GLN -0.19 0.28 1 84 ARG 2.14 0.23 1 86 ILE -4.86 1.72 1 87 THR 3.77 1.81 1 88 MET 2.92 2.98 1 89 HIS 3.61 2.83 1 90 HIS 4.40 -0.35 1 91 PHE 4.60 2.57 1 92 SER 2.18 1.84 1 93 LEU 8.03 0.16 1 94 VAL 4.90 1.66 1 95 ALA 2.65 4.66 1 97 HIS 4.66 0.62 1 98 LEU 4.95 2.69 1 99 ALA 4.12 3.10 1 100 ASP 3.09 3.15 1 101 ALA 3.67 0.82 1 102 LEU 6.54 4.07 1 103 THR 3.53 0.62 1 104 ALA -0.23 -0.32 1 105 ALA 4.65 2.17 1 110 GLU 5.34 1.36 1 111 THR 8.48 1.19 1 112 ILE 6.37 2.28 1 113 THR 3.34 2.96 1 114 GLU 6.41 1.47 1 115 ILE 4.94 2.02 1 116 LEU 4.23 1.03 1 118 VAL 0.49 0.29 1 119 ILE 1.88 0.35 1 122 LEU 5.72 1.96 1 123 ALA 4.14 0.48 1 124 VAL 1.23 2.42 1 125 ASP 4.54 -0.16 1 126 VAL -1.76 0.73 1 127 THR 0.61 1.04 1 128 SER -0.63 0.12 1 130 GLU -0.10 0.30 1 131 SER 0.09 -0.02 1 132 THR -0.20 -0.83 1 stop_ save_